N-(4-chloranyl-2-methyl-phenyl)-4-cyclohexylcarbonyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-4-cyclohexylcarbonyl-piperazine-1-carbothioamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide CAS Name: N-(4-chloro-2-methylphenyl)-4-[cyclohexyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-chloro-2-methylphenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-4-(cyclohexanecarbonyl)piperazine-1-carbothioamide Formula: C19H26ClN3OS MolecularWeight: 379.94724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=S)N2CCN(CC2)C(=O)C3CCCCC3

InChI

InChI=1S/C19H26ClN3OS/c1-14-13-16(20)7-8-17(14)21-19(25)23-11-9-22(10-12-23)18(24)15-5-3-2-4-6-15/h7-8,13,15H,2-6,9-12H2,1H3,(H,21,25)